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Recent progress in large language models (LLM) found chain-of-thought prompting strategies to improve the reasoning ability of LLMs by encouraging problem solving through multiple steps. Therefore, subsequent research aimed to integrate the…

Computation and Language · Computer Science 2025-02-21 Ting-Ruen Wei , Haowei Liu , Xuyang Wu , Yi Fang

Recently, large language models (LLMs) have notably positioned them as capable tools for addressing complex optimization challenges. Despite this recognition, a predominant limitation of existing LLM-based optimization methods is their…

Artificial Intelligence · Computer Science 2024-03-05 Yuxiao Huang , Wenjie Zhang , Liang Feng , Xingyu Wu , Kay Chen Tan

Large Language Models (LLMs) have shown notable potential in code generation for optimization algorithms, unlocking exciting new opportunities. This paper examines how LLMs, rather than creating algorithms from scratch, can improve existing…

Artificial Intelligence · Computer Science 2025-07-22 Camilo Chacón Sartori , Christian Blum

Large Language Models (LLMs) have shown remarkable capabilities in natural language processing, mathematical problem solving, and tasks related to program synthesis. However, their effectiveness in long-term planning and higher-order…

Artificial Intelligence · Computer Science 2024-10-08 Erik Wu , Sayan Mitra

Molecular design involves an enormous and irregular search space, where traditional optimizers such as Bayesian optimization, genetic algorithms, and generative models struggle to leverage expert knowledge or handle complex feedback.…

Machine Learning · Computer Science 2025-12-09 Nian Ran , Yue Wang , Xiaoyuan Zhang , Zhongzheng Li , Qingsong Ran , Wenhao Li , Richard Allmendinger

Large Language Models (LLMs) generate responses to questions; however, their effectiveness is often hindered by sub-optimal quality of answers and occasional failures to provide accurate responses to questions. To address these challenges,…

Computation and Language · Computer Science 2024-02-06 Liang Zhang , Katherine Jijo , Spurthi Setty , Eden Chung , Fatima Javid , Natan Vidra , Tommy Clifford

A significant barrier to the widespread adoption of Bayesian inference is the specification of prior distributions and likelihoods, which often requires specialized statistical expertise. This paper investigates the feasibility of using a…

Artificial Intelligence · Computer Science 2025-08-13 Yongchao Huang

Large language models (LLMs) are increasingly used as agents that interact with users and with the world. To do so successfully, LLMs must construct representations of the world and form probabilistic beliefs about them. To provide…

Computation and Language · Computer Science 2026-01-16 Linlu Qiu , Fei Sha , Kelsey Allen , Yoon Kim , Tal Linzen , Sjoerd van Steenkiste

Fine-tuning Large Language Models (LLMs) with Low-Rank Adaptation (LoRA) offers a resource-efficient way to personalize or specialize. However, LoRA is highly sensitive to hyperparameter choices, and exhaustive hyperparameter search is…

Computation and Language · Computer Science 2026-05-29 Baek Seong-Eun , Lee Jung-Mok , Kim Sung-Bin , Tae-Hyun Oh

This paper presents a comprehensive evaluation of cost-efficient Large Language Models (LLMs) for diverse biomedical tasks spanning both text and image modalities. We evaluated a range of closed-source and open-source LLMs on tasks such as…

Computation and Language · Computer Science 2025-07-21 Israt Jahan , Md Tahmid Rahman Laskar , Chun Peng , Jimmy Huang

This paper explores the use of foundational large language models (LLMs) in hyperparameter optimization (HPO). Hyperparameters are critical in determining the effectiveness of machine learning models, yet their optimization often relies on…

Machine Learning · Computer Science 2024-11-12 Michael R. Zhang , Nishkrit Desai , Juhan Bae , Jonathan Lorraine , Jimmy Ba

Large Language Models (LLMs) have demonstrated remarkable capabilities in software engineering, yet comprehensive benchmarks covering diverse SE activities remain limited. We present a multi-task evaluation of 11 state-of-the-art LLMs…

Software Engineering · Computer Science 2026-02-10 Go Frendi Gunawan , Mukhlis Amien

Large language models (LLMs) have shown strong results on a range of applications, including regression and scoring tasks. Typically, one obtains outputs from an LLM via autoregressive sampling from the model's output distribution. We show…

Computation and Language · Computer Science 2024-11-04 Michal Lukasik , Harikrishna Narasimhan , Aditya Krishna Menon , Felix Yu , Sanjiv Kumar

This paper introduces Bayesian Hierarchical Low-Rank Adaption (BoRA), a novel method for finetuning multi-task Large Language Models (LLMs). Current finetuning approaches, such as Low-Rank Adaption (LoRA), perform exeptionally well in…

Machine Learning · Computer Science 2025-01-08 Simen Eide , Arnoldo Frigessi

The sequential recommendation problem has attracted considerable research attention in the past few years, leading to the rise of numerous recommendation models. In this work, we explore how Large Language Models (LLMs), which are nowadays…

Information Retrieval · Computer Science 2025-01-14 Artun Boz , Wouter Zorgdrager , Zoe Kotti , Jesse Harte , Panos Louridas , Dietmar Jannach , Vassilios Karakoidas , Marios Fragkoulis

Large language models (LLMs) have been widely adopted due to their remarkable performance across various applications, driving the accelerated development of a large number of diverse models. However, these individual LLMs show limitations…

Computation and Language · Computer Science 2025-06-13 Kaushal Kumar Maurya , KV Aditya Srivatsa , Ekaterina Kochmar

Tool learning aims to enhance and expand large language models' (LLMs) capabilities with external tools, which has gained significant attention recently. Current methods have shown that LLMs can effectively handle a certain amount of tools…

Computation and Language · Computer Science 2024-10-01 Qiancheng Xu , Yongqi Li , Heming Xia , Wenjie Li

Large Language Model (LLM) agents significantly extend the capabilities of standalone LLMs, empowering them to interact with external tools (e.g., APIs, functions) and complete various tasks in a self-directed fashion. The challenge of tool…

Artificial Intelligence · Computer Science 2024-02-19 Weizhou Shen , Chenliang Li , Hongzhan Chen , Ming Yan , Xiaojun Quan , Hehong Chen , Ji Zhang , Fei Huang

Large language models (LLMs) excel at explicit reasoning, but their implicit computational strategies remain underexplored. Decades of psychophysics research show that humans intuitively process and integrate noisy signals using…

Computation and Language · Computer Science 2025-12-03 Julian Ma , Jun Wang , Zafeirios Fountas

In sequential decision-making (SDM) tasks, methods like reinforcement learning (RL) and heuristic search have made notable advances in specific cases. However, they often require extensive exploration and face challenges in generalizing…

Machine Learning · Computer Science 2024-10-11 Xue Yan , Yan Song , Xidong Feng , Mengyue Yang , Haifeng Zhang , Haitham Bou Ammar , Jun Wang